SCHEMBL12430364

SCHEMBL12430364

C=C(C)C(=O)OCC(C)OCC1CCCO1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.47
ALDH1A1 P00352 2/20 0.47
LMNA P02545 2/20 0.43
POLB P06746 1/20 0.43
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HTT P42858 1/20 0.36
HPGD P15428 1/20 0.34
GAA P10253 1/20 0.34
MAPK1 P28482 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL21279993 1.00 TSHR (0.47) TSHRALDH1A1LMNAPOLBKMT2A
SCHEMBL12744526 0.97 TSHR (0.45) TSHRALDH1A1LMNAPOLBKMT2A
SCHEMBL4866874 0.85 ALDH1A1 (0.66) TSHRALDH1A1
SCHEMBL21279990 0.83 LMNA (0.48) ALDH1A1LMNAPOLBKMT2AMEN1
SCHEMBL36133 0.83 ALDH1A1 (0.67) ALDH1A1LMNAPOLBKMT2AMEN1
SCHEMBL27848264 0.83 ALDH1A1 (0.67) ALDH1A1LMNAPOLBKMT2AMEN1
SCHEMBL8679177 0.83 ALDH1A1 (0.55) TSHRALDH1A1LMNAPOLBKMT2A
SCHEMBL7094241 0.82 TSHR (0.49) TSHRALDH1A1LMNAPOLBKMT2A
SCHEMBL28309955 0.82 ALDH1A1 (0.65) ALDH1A1LMNAPOLBKMT2AMEN1
SCHEMBL12430362 0.82 LMNA (0.40) TSHRALDH1A1LMNAPOLBKMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3101072-B1 INKJET INK COMPOSITION FOR PRINTING ON BUILDING MATERIALS, INKJET INK SET FOR PRINTING ON BUILDING MATERIALS, INKJET RECORDING METHOD, AND DECORATIVE BUILDING MATERIALS FUJIFILM CORP (JP) 2019-08-28 EP disclosed
EP-2502967-B1 Ink composition FUJIFILM SPECIALITY INK SYSTEMS LTD (GB) 2019-08-21 EP disclosed
EP-2298841-B1 Ink composition, and inkjet recording method FUJIFILM CORP (JP) 2017-10-25 EP disclosed
US-8361563-B2 Ink composition and inkjet recording method FUJIFILM CORPORATION (JP) 2013-01-29 US disclosed
US-8361563-B2 Ink composition and inkjet recording method FUJIFILM CORPORATION (JP) 2013-01-29 US disclosed
EP-2230284-B1 Ink composition and inkjet recording method FUJIFILM CORP (JP) 2011-08-03 EP disclosed
US-20110071239-A1 INK COMPOSITION AND INKJET RECORDING METHOD FUJIFILM CORPORATION (JP) 2011-03-24 US disclosed
US-20110071239-A1 INK COMPOSITION AND INKJET RECORDING METHOD FUJIFILM CORPORATION (JP) 2011-03-24 US disclosed
EP-2298841-A1 Ink composition, and inkjet recording method FUJIFILM Corporation (JP) 2011-03-23 EP disclosed
US-20100239779-A1 INK COMPOSITION AND INKJET RECORDING METHOD FUJIFILM CORPORATION (JP) 2010-09-23 US disclosed
US-20100239779-A1 INK COMPOSITION AND INKJET RECORDING METHOD FUJIFILM CORPORATION (JP) 2010-09-23 US disclosed
EP-2230284-A1 Ink composition and inkjet recording method Fujifilm Corporation (JP) 2010-09-22 EP disclosed